Chem
J-GLOBAL ID:200907043014040960
Nikkaji number:J1.590.891B
(3S)-N-Phenyl-3β-isopropyl-6,6-dimethyl-1,2,4-trioxane-5β-amine
(3S)-N-フェニル-3β-イソプロピル-6,6-ジメチル-1,2,4-トリオキサン-5β-アミン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C14 H21 NO3
Molecular formula furigana:
C14-H21-N-O3
Molecular weight:
251.326
InChI:
InChI=1S/C14H21NO3/c1-10(2)12-16-13(14(3,4)18-17-12)15-11-8-6-5-7-9-11/h5-10,12-13,15H,1-4H3/t12-,13+/m0/s1
InChI key:
RTZKCAXBKRHORO-QWHCGFSZSA-N
SMILES:
CC(C)[C@@H]1OOC(C)(C)[C@H](Nc2ccccc2)O1
Systematic name (3):
(3S)-N-フェニル-3β-イソプロピル-6,6-ジメチル-1,2,4-トリオキサン-5β-アミン
(3S,5R)-6,6-ジメチル-N-フェニル-3-(プロパン-2-イル)-1,2,4-トリオキサン-5-アミン
(3S,5R)-6,6-dimethyl-N-phenyl-3-(propan-2-yl)-1,2,4-trioxan-5-amine
Other name (1):
(3S)-N-Phenyl-3β-isopropyl-6,6-dimethyl-1,2,4-trioxane-5β-amine
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